6-[2-(4-bromophenyl)-2-oxoethyl]-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5(6H)-one
Chemical Structure Depiction of
6-[2-(4-bromophenyl)-2-oxoethyl]-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5(6H)-one
6-[2-(4-bromophenyl)-2-oxoethyl]-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5(6H)-one
Compound characteristics
| Compound ID: | C695-0054 |
| Compound Name: | 6-[2-(4-bromophenyl)-2-oxoethyl]-2-phenyl[1,2,4]triazolo[1,5-c]quinazolin-5(6H)-one |
| Molecular Weight: | 459.3 |
| Molecular Formula: | C23 H15 Br N4 O2 |
| Smiles: | C(C(c1ccc(cc1)[Br])=O)N1C(n2c(c3ccccc13)nc(c1ccccc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9351 |
| logD: | 4.9351 |
| logSw: | -4.9622 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.342 |
| InChI Key: | VRDPLGFAGZDZLZ-UHFFFAOYSA-N |